SCHEMBL9765299

SCHEMBL9765299

CCC(NS(=O)(=O)c1ccccc1)c1ccc(OCc2ccccc2)c(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.51
HPGD P15428 2/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
ACHE P22303 1/20 0.47
F2 P00734 2/20 0.46
F10 P00742 2/20 0.46
PRSS1 P07477 2/20 0.46
F7 P08709 2/20 0.46
PRSS2 P07478 1/20 0.46
F3 P13726 1/20 0.46
PRSS3 P35030 1/20 0.46
HTT P42858 2/20 0.46
POLB P06746 3/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
GAA P10253 1/20 0.45
NPSR1 Q6W5P4 2/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9765324 0.83 ALDH1A1 (0.48) SMN1; SMN2HPGDHTTPOLBKMT2A
SCHEMBL28344001 0.80 NPC1 (0.56) SMN1; SMN2HPGDNPC1RAB9ACA1
SCHEMBL28344002 0.80 NPC1 (0.56) SMN1; SMN2HPGDNPC1RAB9ACA1
SCHEMBL9765288 0.80 ADRA1D (0.56) HPGDNPC1RAB9AHTTPOLB
SCHEMBL9765264 0.76 KCNA5 (0.55) SMN1; SMN2NPC1RAB9AHTTPOLB
SCHEMBL9765306 0.76 KCNA5 (0.55) SMN1; SMN2NPC1RAB9AHTTPOLB
SCHEMBL7860111 0.76 F7 (0.58) CA1CA2ACHEF2F10
SCHEMBL12738664 0.75 NPC1 (0.55) SMN1; SMN2HPGDNPC1RAB9AF2
SCHEMBL16973419 0.74 HPGD (0.50) SMN1; SMN2HPGDNPC1RAB9ACA1
SCHEMBL19734616 0.73 NPC1 (0.57) SMN1; SMN2HPGDNPC1RAB9AF2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0255728-B1 PHENOXYACETIC ACID COMPOUNDS, THEIR PREPARATION, PHARMACEUTICAL COMPOSITION AND USE TANABE SEIYAKU CO., LTD. (JP) 1991-11-27 EP disclosed
EP-0255728-A2 Phenoxyacetic acid compounds, their preparation, pharmaceutical composition and use TANABE SEIYAKU CO., LTD. (JP) 1988-02-10 EP disclosed